2QZZ
Structure of Eugenol Synthase from Ocimum basilicum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.2 |
| Synchrotron site | ALS |
| Beamline | 8.2.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-06-21 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.033, 85.387, 76.876 |
| Unit cell angles | 90.00, 107.51, 90.00 |
Refinement procedure
| Resolution | 34.120 - 1.600 |
| Rwork | 0.259 |
| R-free | 0.28700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2qw8 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.300 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 34.139 | 34.140 | 1.580 |
| High resolution limit [Å] | 1.500 | 4.740 | 1.500 |
| Rmerge | 0.133 | 0.100 | 0.681 |
| Total number of observations | 16212 | 34246 | |
| Number of reflections | 104313 | ||
| <I/σ(I)> | 3.4 | 5.2 | 1 |
| Completeness [%] | 97.9 | 99.2 | 95.1 |
| Redundancy | 4.2 | 4.7 | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 277 | 0.1 M sodium succinate, 21% PEG 3350, 0.3 M KCl, 2 mM dithiothreitol, 5 mM NADP+, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
